N-(8-chloranyl-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethyl-benzamide

Systemtic Name: N-(8-chloranyl-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethyl-benzamide Openeye Name: N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethyl-benzamide CAS Name: N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethylbenzamide IUPAC Name: N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethylbenzamide Traditional Name: N-(8-chloro-2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)-3-cyano-4-ethyl-benzamide Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=C2)C(CN(C3)C)(C)C)Cl)C#N

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(C=C2)C(CN(C3)C)(C)C)Cl)C#N

InChI

InChI=1S/C22H24ClN3O/c1-5-14-6-7-15(10-16(14)11-24)21(27)25-19-9-8-18-17(20(19)23)12-26(4)13-22(18,2)3/h6-10H,5,12-13H2,1-4H3,(H,25,27)